Compound Detail
CHEMBL38887
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Basic Information
| ChEMBL ID | CHEMBL38887 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XXFFCDUWEMXOMA-WZWJOCATSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
231.2
MW (Da)
0.00
ALogP
5
HBA
2
HBD
71.1
PSA (Ų)
0.52
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus CHEMBL613758 | EC50 | 5.44 | 5.44 | 3600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus | EC50 | = | 3600.0 | nM | 5.44 | Compound concentration required to inhibit the viral cell proliferation by 50% a... | 9873396 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9873396 | 10.1016/s0960-894x(98)00277-7 | Hepatitis B virus | 1 |
| 9873396 | 10.1016/s0960-894x(98)00277-7 | Human immunodeficiency virus | 1 |
| 9873396 | 10.1016/s0960-894x(98)00277-7 | Unchecked | 1 |
| 9873396 | 10.1016/s0960-894x(98)00277-7 | CCRF-CEM | 1 |
Data from ChEMBL 36 via Core Engine